5-tert-butyl-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Chemical Structure Depiction of
5-tert-butyl-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
5-tert-butyl-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
Compound characteristics
| Compound ID: | S638-0173 |
| Compound Name: | 5-tert-butyl-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide |
| Molecular Weight: | 372.47 |
| Molecular Formula: | C19 H28 N6 O2 |
| Smiles: | CC(C)(C)C1CCc2c(C1)c(C(NC1CCC3=NNC(N3CC1)=O)=O)n[nH]2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6302 |
| logD: | 2.6237 |
| logSw: | -2.545 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.017 |
| InChI Key: | ZINHDHHUYZIXRQ-UHFFFAOYSA-N |